N-[[4-(3-chlorophenyl)-1-[(cyanoamino)-phenoxy-methyl]piperidin-4-yl]methyl]-2-methoxy-benzamide

Systemtic Name: N-[[4-(3-chlorophenyl)-1-[(cyanoamino)-phenoxy-methyl]piperidin-4-yl]methyl]-2-methoxy-benzamide Openeye Name: N-[[4-(3-chlorophenyl)-1-[(cyanoamino)-phenoxy-methyl]-4-piperidyl]methyl]-2-methoxy-benzamide CAS Name: N-[[4-(3-chlorophenyl)-1-[(cyanoamino)-phenoxymethyl]-4-piperidinyl]methyl]-2-methoxybenzamide IUPAC Name: N-[[4-(3-chlorophenyl)-1-[(cyanoamino)-phenoxymethyl]piperidin-4-yl]methyl]-2-methoxybenzamide Traditional Name: N-[[4-(3-chlorophenyl)-1-[(cyanoamino)-phenoxy-methyl]-4-piperidyl]methyl]-2-methoxy-benzamide Formula: C28H29ClN4O3 MolecularWeight: 505.00786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(NC#N)OC3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1C(=O)NCC2(CCN(CC2)C(NC#N)OC3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H29ClN4O3/c1-35-25-13-6-5-12-24(25)26(34)31-19-28(21-8-7-9-22(29)18-21)14-16-33(17-15-28)27(32-20-30)36-23-10-3-2-4-11-23/h2-13,18,27,32H,14-17,19H2,1H3,(H,31,34)