2-[[2-hydroxyethyl(phenethyl)carbamoyl]amino]-N-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)propanamide

Systemtic Name: 2-[[2-hydroxyethyl(phenethyl)carbamoyl]amino]-N-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)propanamide Openeye Name: 2-[[2-hydroxyethyl(phenethyl)carbamoyl]amino]-N-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)propanamide CAS Name: 2-[[[2-hydroxyethyl(phenethyl)amino]-oxomethyl]amino]-N-[3-(1-imidazolyl)propyl]-3-(4-nitrophenyl)propanamide IUPAC Name: 2-[[2-hydroxyethyl(phenethyl)carbamoyl]amino]-N-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)propanamide Traditional Name: 2-[[2-hydroxyethyl(phenethyl)carbamoyl]amino]-N-(3-imidazol-1-ylpropyl)-3-(4-nitrophenyl)propionamide Formula: C26H32N6O5 MolecularWeight: 508.56948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CCO)C(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NCCCN3C=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)CCN(CCO)C(=O)NC(CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NCCCN3C=CN=C3

InChI

InChI=1S/C26H32N6O5/c33-18-17-31(15-11-21-5-2-1-3-6-21)26(35)29-24(19-22-7-9-23(10-8-22)32(36)37)25(34)28-12-4-14-30-16-13-27-20-30/h1-3,5-10,13,16,20,24,33H,4,11-12,14-15,17-19H2,(H,28,34)(H,29,35)