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

Systemtic Name: 2-chloranyl-4-nitro-N-[3-[(2-oxidanylidenechromen-4-yl)amino]propyl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-chloro-4-nitro-N-[3-[(2-oxochromen-4-yl)amino]propyl]benzamide CAS Name: 2-chloro-4-nitro-N-[3-[(2-oxo-1-benzopyran-4-yl)amino]propyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-chloro-4-nitro-N-[3-[(2-oxochromen-4-yl)amino]propyl]benzamide Traditional Name: N-benzyl-2-chloro-N-[3-[(2-ketochromen-4-yl)amino]propyl]-4-nitro-benzamide Formula: C26H22ClN3O5 MolecularWeight: 491.92298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22ClN3O5/c27-22-15-19(30(33)34)11-12-20(22)26(32)29(17-18-7-2-1-3-8-18)14-6-13-28-23-16-25(31)35-24-10-5-4-9-21(23)24/h1-5,7-12,15-16,28H,6,13-14,17H2