3-[[2,3-bis(chloranyl)phenyl]carbamoyl-butan-2-yl-amino]-N-(4-heptylphenyl)propanamide

Systemtic Name: 3-[[2,3-bis(chloranyl)phenyl]carbamoyl-butan-2-yl-amino]-N-(4-heptylphenyl)propanamide Openeye Name: 3-[(2,3-dichlorophenyl)carbamoyl-sec-butyl-amino]-N-(4-heptylphenyl)propanamide CAS Name: 3-[butan-2-yl-[(2,3-dichloroanilino)-oxomethyl]amino]-N-(4-heptylphenyl)propanamide IUPAC Name: 3-[butan-2-yl-[(2,3-dichlorophenyl)carbamoyl]amino]-N-(4-heptylphenyl)propanamide Traditional Name: 3-[(2,3-dichlorophenyl)carbamoyl-sec-butyl-amino]-N-(4-heptylphenyl)propionamide Formula: C27H37Cl2N3O2 MolecularWeight: 506.50758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)NC(=O)CCN(C(C)CC)C(=O)NC2=C(C(=CC=C2)Cl)Cl

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)NC(=O)CCN(C(C)CC)C(=O)NC2=C(C(=CC=C2)Cl)Cl

InChI

InChI=1S/C27H37Cl2N3O2/c1-4-6-7-8-9-11-21-14-16-22(17-15-21)30-25(33)18-19-32(20(3)5-2)27(34)31-24-13-10-12-23(28)26(24)29/h10,12-17,20H,4-9,11,18-19H2,1-3H3,(H,30,33)(H,31,34)