3-(2-naphthalen-1-ylethanoylamino)-3-[3-nitro-4-(pentan-3-ylamino)phenyl]propanamide

Systemtic Name: 3-(2-naphthalen-1-ylethanoylamino)-3-[3-nitro-4-(pentan-3-ylamino)phenyl]propanamide Openeye Name: 3-[4-(1-ethylpropylamino)-3-nitro-phenyl]-3-[[2-(1-naphthyl)acetyl]amino]propanamide CAS Name: 3-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-3-[3-nitro-4-(pentan-3-ylamino)phenyl]propanamide IUPAC Name: 3-[(2-naphthalen-1-ylacetyl)amino]-3-[3-nitro-4-(pentan-3-ylamino)phenyl]propanamide Traditional Name: 3-[4-(1-ethylpropylamino)-3-nitro-phenyl]-3-[[2-(1-naphthyl)acetyl]amino]propionamide Formula: C26H30N4O4 MolecularWeight: 462.5408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C=C1)C(CC(=O)N)NC(=O)CC2=CC=CC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NC1=C(C=C(C=C1)C(CC(=O)N)NC(=O)CC2=CC=CC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C26H30N4O4/c1-3-20(4-2)28-22-13-12-19(14-24(22)30(33)34)23(16-25(27)31)29-26(32)15-18-10-7-9-17-8-5-6-11-21(17)18/h5-14,20,23,28H,3-4,15-16H2,1-2H3,(H2,27,31)(H,29,32)