N-[2-(azepan-1-yl)ethyl]-4-chloranyl-3-[(3,4-dichlorophenyl)carbamoylamino]benzamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-4-chloranyl-3-[(3,4-dichlorophenyl)carbamoylamino]benzamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-4-chloro-3-[(3,4-dichlorophenyl)carbamoylamino]benzamide CAS Name: N-[2-(1-azepanyl)ethyl]-4-chloro-3-[[(3,4-dichloroanilino)-oxomethyl]amino]benzamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-4-chloro-3-[(3,4-dichlorophenyl)carbamoylamino]benzamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-4-chloro-3-[(3,4-dichlorophenyl)carbamoylamino]benzamide Formula: C22H25Cl3N4O2 MolecularWeight: 483.8185

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNC(=O)C2=CC(=C(C=C2)Cl)NC(=O)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)CCNC(=O)C2=CC(=C(C=C2)Cl)NC(=O)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H25Cl3N4O2/c23-17-8-6-16(14-19(17)25)27-22(31)28-20-13-15(5-7-18(20)24)21(30)26-9-12-29-10-3-1-2-4-11-29/h5-8,13-14H,1-4,9-12H2,(H,26,30)(H2,27,28,31)