(2S)-1-(4-azanylpiperidin-1-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one

Systemtic Name: (2S)-1-(4-azanylpiperidin-1-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one Openeye Name: (2S)-1-(4-amino-1-piperidyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one CAS Name: (2S)-1-(4-amino-1-piperidinyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-butanone IUPAC Name: (2S)-1-(4-aminopiperidin-1-yl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methylbutan-1-one Traditional Name: (2S)-1-(4-aminopiperidino)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-butan-1-one Formula: C19H29N3O MolecularWeight: 315.45306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCC(CC1)N)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)[C@@H](C(=O)N1CCC(CC1)N)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C19H29N3O/c1-14(2)18(19(23)21-11-8-17(20)9-12-21)22-10-7-15-5-3-4-6-16(15)13-22/h3-6,14,17-18H,7-13,20H2,1-2H3/t18-/m0/s1