N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-N'-[1-(phenylmethyl)piperidin-4-yl]ethanediamide

Systemtic Name: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-N'-[1-(phenylmethyl)piperidin-4-yl]ethanediamide Openeye Name: N'-(1-benzyl-4-piperidyl)-N-(isochroman-1-ylmethyl)oxamide CAS Name: N-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)-N'-[1-(phenylmethyl)-4-piperidinyl]oxamide IUPAC Name: N'-(1-benzylpiperidin-4-yl)-N-(3,4-dihydro-1H-isochromen-1-ylmethyl)oxamide Traditional Name: N'-(1-benzyl-4-piperidyl)-N-(isochroman-1-ylmethyl)oxamide Formula: C24H29N3O3 MolecularWeight: 407.50536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C(=O)NCC2C3=CC=CC=C3CCO2)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)C(=O)NCC2C3=CC=CC=C3CCO2)CC4=CC=CC=C4

InChI

InChI=1S/C24H29N3O3/c28-23(25-16-22-21-9-5-4-8-19(21)12-15-30-22)24(29)26-20-10-13-27(14-11-20)17-18-6-2-1-3-7-18/h1-9,20,22H,10-17H2,(H,25,28)(H,26,29)