3-[2-(4-chlorophenyl)ethanoylamino]-3-[4-(cycloheptylamino)-3-nitro-phenyl]propanamide

Systemtic Name: 3-[2-(4-chlorophenyl)ethanoylamino]-3-[4-(cycloheptylamino)-3-nitro-phenyl]propanamide Openeye Name: 3-[[2-(4-chlorophenyl)acetyl]amino]-3-[4-(cycloheptylamino)-3-nitro-phenyl]propanamide CAS Name: 3-[[2-(4-chlorophenyl)-1-oxoethyl]amino]-3-[4-(cycloheptylamino)-3-nitrophenyl]propanamide IUPAC Name: 3-[[2-(4-chlorophenyl)acetyl]amino]-3-[4-(cycloheptylamino)-3-nitrophenyl]propanamide Traditional Name: 3-[[2-(4-chlorophenyl)acetyl]amino]-3-[4-(cycloheptylamino)-3-nitro-phenyl]propionamide Formula: C24H29ClN4O4 MolecularWeight: 472.96446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=C(C=C(C=C2)C(CC(=O)N)NC(=O)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CC1)NC2=C(C=C(C=C2)C(CC(=O)N)NC(=O)CC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H29ClN4O4/c25-18-10-7-16(8-11-18)13-24(31)28-21(15-23(26)30)17-9-12-20(22(14-17)29(32)33)27-19-5-3-1-2-4-6-19/h7-12,14,19,21,27H,1-6,13,15H2,(H2,26,30)(H,28,31)