N-[(S)-cyclopropyl-(4-methylphenyl)methyl]-3-nitro-benzamide

Systemtic Name: N-[(S)-cyclopropyl-(4-methylphenyl)methyl]-3-nitro-benzamide Openeye Name: N-[(S)-cyclopropyl(p-tolyl)methyl]-3-nitro-benzamide CAS Name: N-[(S)-cyclopropyl-(4-methylphenyl)methyl]-3-nitrobenzamide IUPAC Name: N-[(S)-cyclopropyl-(4-methylphenyl)methyl]-3-nitrobenzamide Traditional Name: N-[(S)-cyclopropyl(p-tolyl)methyl]-3-nitro-benzamide Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2CC2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2CC2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O3/c1-12-5-7-13(8-6-12)17(14-9-10-14)19-18(21)15-3-2-4-16(11-15)20(22)23/h2-8,11,14,17H,9-10H2,1H3,(H,19,21)/t17-/m1/s1