methyl (3S)-4-piperidin-4-yl-3-[(3S)-1,2,3,4-tetrahydroquinolin-3-yl]butanoate

Systemtic Name: methyl (3S)-4-piperidin-4-yl-3-[(3S)-1,2,3,4-tetrahydroquinolin-3-yl]butanoate Openeye Name: methyl (3S)-4-(4-piperidyl)-3-[(3S)-1,2,3,4-tetrahydroquinolin-3-yl]butanoate CAS Name: (3S)-4-(4-piperidinyl)-3-[(3S)-1,2,3,4-tetrahydroquinolin-3-yl]butanoic acid methyl ester IUPAC Name: methyl (3S)-4-piperidin-4-yl-3-[(3S)-1,2,3,4-tetrahydroquinolin-3-yl]butanoate Traditional Name: (3S)-4-(4-piperidyl)-3-[(3S)-1,2,3,4-tetrahydroquinolin-3-yl]butyric acid methyl ester Formula: C19H28N2O2 MolecularWeight: 316.43782

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC1CCNCC1)C2CC3=CC=CC=C3NC2

Isomeric SMILES

COC(=O)C[C@H](CC1CCNCC1)[C@@H]2CC3=CC=CC=C3NC2

InChI

InChI=1S/C19H28N2O2/c1-23-19(22)12-16(10-14-6-8-20-9-7-14)17-11-15-4-2-3-5-18(15)21-13-17/h2-5,14,16-17,20-21H,6-13H2,1H3/t16-,17+/m0/s1