N-[(3S)-5-(pyrrolidin-1-ylmethyl)-3,4-dihydro-2H-chromen-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: N-[(3S)-5-(pyrrolidin-1-ylmethyl)-3,4-dihydro-2H-chromen-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[(3S)-5-(pyrrolidin-1-ylmethyl)chroman-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[(3S)-5-(1-pyrrolidinylmethyl)-3,4-dihydro-2H-1-benzopyran-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[(3S)-5-(pyrrolidin-1-ylmethyl)-3,4-dihydro-2H-chromen-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[(3S)-5-(pyrrolidinomethyl)chroman-3-yl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=C3CC(COC3=CC=C2)NC(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCN(C1)CC2=C3C[C@@H](COC3=CC=C2)NC(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C24H29N3O2/c28-24(27-13-10-18-6-1-2-7-19(18)16-27)25-21-14-22-20(15-26-11-3-4-12-26)8-5-9-23(22)29-17-21/h1-2,5-9,21H,3-4,10-17H2,(H,25,28)/t21-/m0/s1