N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-chlorophenyl)methylamino]-3-nitro-benzamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-chlorophenyl)methylamino]-3-nitro-benzamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-chlorophenyl)methylamino]-3-nitro-benzamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-chlorophenyl)methylamino]-3-nitrobenzamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-[(2-chlorophenyl)methylamino]-3-nitrobenzamide Traditional Name: 4-[(2-chlorobenzyl)amino]-N-homopiperonyl-3-nitro-benzamide Formula: C23H20ClN3O5 MolecularWeight: 453.875

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4Cl)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)C3=CC(=C(C=C3)NCC4=CC=CC=C4Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H20ClN3O5/c24-18-4-2-1-3-17(18)13-26-19-7-6-16(12-20(19)27(29)30)23(28)25-10-9-15-5-8-21-22(11-15)32-14-31-21/h1-8,11-12,26H,9-10,13-14H2,(H,25,28)