3-nitro-4-(1-phenylbutylamino)benzamide

Systemtic Name: 3-nitro-4-(1-phenylbutylamino)benzamide Openeye Name: 3-nitro-4-(1-phenylbutylamino)benzamide CAS Name: 3-nitro-4-(1-phenylbutylamino)benzamide IUPAC Name: 3-nitro-4-(1-phenylbutylamino)benzamide Traditional Name: 3-nitro-4-(1-phenylbutylamino)benzamide Formula: C17H19N3O3 MolecularWeight: 313.35106

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O3/c1-2-6-14(12-7-4-3-5-8-12)19-15-10-9-13(17(18)21)11-16(15)20(22)23/h3-5,7-11,14,19H,2,6H2,1H3,(H2,18,21)