N-butan-2-yl-4-chloranyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-butan-2-yl-4-chloranyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxo-ethyl]-3-nitro-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-4-chloro-N-[2-[(4-fluorophenyl)methyl-[(4-oxo-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-butan-2-yl-4-chloro-N-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-[(4-fluorobenzyl)-[(4-ketochromen-3-yl)methyl]amino]-2-keto-ethyl]-3-nitro-N-sec-butyl-benzamide Formula: C30H27ClFN3O6 MolecularWeight: 580.003283

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=C(C=C1)F)CC2=COC3=CC=CC=C3C2=O)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C30H27ClFN3O6/c1-3-19(2)34(30(38)21-10-13-25(31)26(14-21)35(39)40)17-28(36)33(15-20-8-11-23(32)12-9-20)16-22-18-41-27-7-5-4-6-24(27)29(22)37/h4-14,18-19H,3,15-17H2,1-2H3