1-(4-chlorophenyl)carbonyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]piperidine-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)carbonyl-N-[4-(prop-2-enylcarbamoylamino)phenyl]piperidine-3-carboxamide Openeye Name: N-[4-(allylcarbamoylamino)phenyl]-1-(4-chlorobenzoyl)piperidine-3-carboxamide CAS Name: 1-[(4-chlorophenyl)-oxomethyl]-N-[4-[[oxo-(prop-2-enylamino)methyl]amino]phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-chlorobenzoyl)-N-[4-(prop-2-enylcarbamoylamino)phenyl]piperidine-3-carboxamide Traditional Name: N-[4-(allylcarbamoylamino)phenyl]-1-(4-chlorobenzoyl)nipecotamide Formula: C23H25ClN4O3 MolecularWeight: 440.9226

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C=CCNC(=O)NC1=CC=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H25ClN4O3/c1-2-13-25-23(31)27-20-11-9-19(10-12-20)26-21(29)17-4-3-14-28(15-17)22(30)16-5-7-18(24)8-6-16/h2,5-12,17H,1,3-4,13-15H2,(H,26,29)(H2,25,27,31)