4-[2-(3-bromophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]-3-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-N-[(4-methylphenyl)methyl]benzamide

Systemtic Name: 4-[2-(3-bromophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]-3-[(4-chloranyl-3-nitro-phenyl)carbonylamino]-N-[(4-methylphenyl)methyl]benzamide Openeye Name: 4-[2-(3-bromophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]-3-[(4-chloro-3-nitro-benzoyl)amino]-N-(p-tolylmethyl)benzamide CAS Name: 4-[2-(3-bromophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]-3-[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]-N-[(4-methylphenyl)methyl]benzamide IUPAC Name: 4-[2-(3-bromophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]-3-[(4-chloro-3-nitrobenzoyl)amino]-N-[(4-methylphenyl)methyl]benzamide Traditional Name: 4-[2-(3-bromophenyl)-4-oxa-3,8-diazaspiro[4.5]dec-2-en-8-yl]-3-[(4-chloro-3-nitro-benzoyl)amino]-N-(4-methylbenzyl)benzamide Formula: C35H31BrClN5O5 MolecularWeight: 717.00814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)N3CCC4(CC3)CC(=NO4)C5=CC(=CC=C5)Br)NC(=O)C6=CC(=C(C=C6)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)N3CCC4(CC3)CC(=NO4)C5=CC(=CC=C5)Br)NC(=O)C6=CC(=C(C=C6)Cl)[N+](=O)[O-]

InChI

InChI=1S/C35H31BrClN5O5/c1-22-5-7-23(8-6-22)21-38-33(43)25-10-12-31(29(18-25)39-34(44)26-9-11-28(37)32(19-26)42(45)46)41-15-13-35(14-16-41)20-30(40-47-35)24-3-2-4-27(36)17-24/h2-12,17-19H,13-16,20-21H2,1H3,(H,38,43)(H,39,44)