4-methoxy-N-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-(isopentylamino)-2-oxo-ethyl]-4-methoxy-3-nitro-benzamide CAS Name: 4-methoxy-N-[2-(3-methylbutylamino)-2-oxoethyl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-[2-(3-methylbutylamino)-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-(isoamylamino)-2-keto-ethyl]-4-methoxy-3-nitro-benzamide Formula: C15H21N3O5 MolecularWeight: 323.34434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CNC(=O)C1=CC(=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCNC(=O)CNC(=O)C1=CC(=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O5/c1-10(2)6-7-16-14(19)9-17-15(20)11-4-5-13(23-3)12(8-11)18(21)22/h4-5,8,10H,6-7,9H2,1-3H3,(H,16,19)(H,17,20)