4-methoxy-3-nitro-N-[3-[(2-oxidanylidenechromen-4-yl)amino]propyl]-N-(phenylmethyl)benzamide

Systemtic Name: 4-methoxy-3-nitro-N-[3-[(2-oxidanylidenechromen-4-yl)amino]propyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-methoxy-3-nitro-N-[3-[(2-oxochromen-4-yl)amino]propyl]benzamide CAS Name: 4-methoxy-3-nitro-N-[3-[(2-oxo-1-benzopyran-4-yl)amino]propyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-methoxy-3-nitro-N-[3-[(2-oxochromen-4-yl)amino]propyl]benzamide Traditional Name: N-benzyl-N-[3-[(2-ketochromen-4-yl)amino]propyl]-4-methoxy-3-nitro-benzamide Formula: C27H25N3O6 MolecularWeight: 487.5039

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CCCNC2=CC(=O)OC3=CC=CC=C32)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CCCNC2=CC(=O)OC3=CC=CC=C32)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H25N3O6/c1-35-25-13-12-20(16-23(25)30(33)34)27(32)29(18-19-8-3-2-4-9-19)15-7-14-28-22-17-26(31)36-24-11-6-5-10-21(22)24/h2-6,8-13,16-17,28H,7,14-15,18H2,1H3