3-(aminocarbonylamino)-3-(3-methylphenyl)-N-[2-[(4-nitrophenyl)amino]ethyl]propanamide

Systemtic Name: 3-(aminocarbonylamino)-3-(3-methylphenyl)-N-[2-[(4-nitrophenyl)amino]ethyl]propanamide Openeye Name: 3-(m-tolyl)-N-[2-(4-nitroanilino)ethyl]-3-ureido-propanamide CAS Name: 3-(carbamoylamino)-3-(3-methylphenyl)-N-[2-(4-nitroanilino)ethyl]propanamide IUPAC Name: 3-(carbamoylamino)-3-(3-methylphenyl)-N-[2-(4-nitroanilino)ethyl]propanamide Traditional Name: 3-(m-tolyl)-N-[2-(4-nitroanilino)ethyl]-3-ureido-propionamide Formula: C19H23N5O4 MolecularWeight: 385.41702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(CC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)C(CC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])NC(=O)N

InChI

InChI=1S/C19H23N5O4/c1-13-3-2-4-14(11-13)17(23-19(20)26)12-18(25)22-10-9-21-15-5-7-16(8-6-15)24(27)28/h2-8,11,17,21H,9-10,12H2,1H3,(H,22,25)(H3,20,23,26)