N-[[4-(diethylaminomethyl)phenyl]methyl]-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(2-nitroanilino)propanamide CAS Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(2-nitroanilino)propanamide Traditional Name: N-[4-(diethylaminomethyl)benzyl]-3-(2-nitroanilino)propionamide Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)CNC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)CNC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H28N4O3/c1-3-24(4-2)16-18-11-9-17(10-12-18)15-23-21(26)13-14-22-19-7-5-6-8-20(19)25(27)28/h5-12,22H,3-4,13-16H2,1-2H3,(H,23,26)