4-[(4-chlorophenyl)-phenyl-methyl]-N-[4-methyl-3-(pyrrolidin-1-ylmethyl)-2H-chromen-7-yl]piperazine-1-carboxamide

Systemtic Name: 4-[(4-chlorophenyl)-phenyl-methyl]-N-[4-methyl-3-(pyrrolidin-1-ylmethyl)-2H-chromen-7-yl]piperazine-1-carboxamide Openeye Name: 4-[(4-chlorophenyl)-phenyl-methyl]-N-[4-methyl-3-(pyrrolidin-1-ylmethyl)-2H-chromen-7-yl]piperazine-1-carboxamide CAS Name: 4-[(4-chlorophenyl)-phenylmethyl]-N-[4-methyl-3-(1-pyrrolidinylmethyl)-2H-1-benzopyran-7-yl]-1-piperazinecarboxamide IUPAC Name: 4-[(4-chlorophenyl)-phenylmethyl]-N-[4-methyl-3-(pyrrolidin-1-ylmethyl)-2H-chromen-7-yl]piperazine-1-carboxamide Traditional Name: 4-[(4-chlorophenyl)-phenyl-methyl]-N-[4-methyl-3-(pyrrolidinomethyl)-2H-chromen-7-yl]piperazine-1-carboxamide Formula: C33H37ClN4O2 MolecularWeight: 557.12548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(COC2=C1C=CC(=C2)NC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl)CN6CCCC6

Isomeric SMILES

CC1=C(COC2=C1C=CC(=C2)NC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl)CN6CCCC6

InChI

InChI=1S/C33H37ClN4O2/c1-24-27(22-36-15-5-6-16-36)23-40-31-21-29(13-14-30(24)31)35-33(39)38-19-17-37(18-20-38)32(25-7-3-2-4-8-25)26-9-11-28(34)12-10-26/h2-4,7-14,21,32H,5-6,15-20,22-23H2,1H3,(H,35,39)