[8-(3-nitrophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-phenyl-methanone

Systemtic Name: [8-(3-nitrophenyl)carbonyl-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-phenyl-methanone Openeye Name: [8-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-phenyl-methanone CAS Name: [8-[(3-nitrophenyl)-oxomethyl]-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-phenylmethanone IUPAC Name: [8-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-phenylmethanone Traditional Name: [8-(3-nitrobenzoyl)-4-thia-1,8-diazaspiro[4.5]decan-1-yl]-phenyl-methanone Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12N(CCS2)C(=O)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC12N(CCS2)C(=O)C3=CC=CC=C3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4S/c25-19(17-7-4-8-18(15-17)24(27)28)22-11-9-21(10-12-22)23(13-14-29-21)20(26)16-5-2-1-3-6-16/h1-8,15H,9-14H2