2-[8-[(4-nitrophenyl)methyl]-1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]ethanoic acid

Systemtic Name: 2-[8-[(4-nitrophenyl)methyl]-1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]ethanoic acid Openeye Name: 2-[8-[(4-nitrophenyl)methyl]-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]acetic acid CAS Name: 2-[8-[(4-nitrophenyl)methyl]-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]acetic acid IUPAC Name: 2-[8-[(4-nitrophenyl)methyl]-1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]acetic acid Traditional Name: 2-[1-keto-8-(4-nitrobenzyl)-4-phenyl-2,4,8-triazaspiro[4.5]decan-2-yl]acetic acid Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C(=O)N(CN2C3=CC=CC=C3)CC(=O)O)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC12C(=O)N(CN2C3=CC=CC=C3)CC(=O)O)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O5/c27-20(28)15-24-16-25(18-4-2-1-3-5-18)22(21(24)29)10-12-23(13-11-22)14-17-6-8-19(9-7-17)26(30)31/h1-9H,10-16H2,(H,27,28)