N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-1-(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-1-(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)piperidine-4-carboxamide Openeye Name: N-(isochroman-1-ylmethyl)-1-(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-(3,4-dihydro-1H-2-benzopyran-1-ylmethyl)-1-(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)-4-piperidinecarboxamide IUPAC Name: N-(3,4-dihydro-1H-isochromen-1-ylmethyl)-1-(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-(isochroman-1-ylmethyl)-1-(4-methyl-7,8-dihydro-6H-cyclopenta[g]quinazolin-2-yl)isonipecotamide Formula: C28H32N4O2 MolecularWeight: 456.57928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC3=C(CCC3)C=C12)N4CCC(CC4)C(=O)NCC5C6=CC=CC=C6CCO5

Isomeric SMILES

CC1=NC(=NC2=CC3=C(CCC3)C=C12)N4CCC(CC4)C(=O)NCC5C6=CC=CC=C6CCO5

InChI

InChI=1S/C28H32N4O2/c1-18-24-15-21-6-4-7-22(21)16-25(24)31-28(30-18)32-12-9-20(10-13-32)27(33)29-17-26-23-8-3-2-5-19(23)11-14-34-26/h2-3,5,8,15-16,20,26H,4,6-7,9-14,17H2,1H3,(H,29,33)