N-[3-[(2-ethyl-1-phenyl-butyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(2-ethyl-1-phenyl-butyl)amino]-3-oxidanylidene-propyl]-4-nitro-benzamide Openeye Name: N-[3-[(2-ethyl-1-phenyl-butyl)amino]-3-oxo-propyl]-4-nitro-benzamide CAS Name: N-[3-[(2-ethyl-1-phenylbutyl)amino]-3-oxopropyl]-4-nitrobenzamide IUPAC Name: N-[3-[(2-ethyl-1-phenylbutyl)amino]-3-oxopropyl]-4-nitrobenzamide Traditional Name: N-[3-[(2-ethyl-1-phenyl-butyl)amino]-3-keto-propyl]-4-nitro-benzamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C1=CC=CC=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(CC)C(C1=CC=CC=C1)NC(=O)CCNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O4/c1-3-16(4-2)21(17-8-6-5-7-9-17)24-20(26)14-15-23-22(27)18-10-12-19(13-11-18)25(28)29/h5-13,16,21H,3-4,14-15H2,1-2H3,(H,23,27)(H,24,26)