(3S,4S)-4-(aminomethyl)-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: (3S,4S)-4-(aminomethyl)-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one Openeye Name: (3S,4S)-4-(aminomethyl)-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one CAS Name: (3S,4S)-4-(aminomethyl)-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one IUPAC Name: (3S,4S)-4-(aminomethyl)-2-ethyl-3-propyl-3,4-dihydroisoquinolin-1-one Traditional Name: (3S,4S)-4-(aminomethyl)-2-ethyl-3-propyl-3,4-dihydroisocarbostyril Formula: C15H22N2O MolecularWeight: 246.34798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C2=CC=CC=C2C(=O)N1CC)CN

Isomeric SMILES

CCC[C@H]1[C@@H](C2=CC=CC=C2C(=O)N1CC)CN

InChI

InChI=1S/C15H22N2O/c1-3-7-14-13(10-16)11-8-5-6-9-12(11)15(18)17(14)4-2/h5-6,8-9,13-14H,3-4,7,10,16H2,1-2H3/t13-,14+/m1/s1