(3S,4R)-4-(aminomethyl)-3-(1H-indol-3-yl)-2-propyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: (3S,4R)-4-(aminomethyl)-3-(1H-indol-3-yl)-2-propyl-3,4-dihydroisoquinolin-1-one Openeye Name: (3S,4R)-4-(aminomethyl)-3-(1H-indol-3-yl)-2-propyl-3,4-dihydroisoquinolin-1-one CAS Name: (3S,4R)-4-(aminomethyl)-3-(1H-indol-3-yl)-2-propyl-3,4-dihydroisoquinolin-1-one IUPAC Name: (3S,4R)-4-(aminomethyl)-3-(1H-indol-3-yl)-2-propyl-3,4-dihydroisoquinolin-1-one Traditional Name: (3S,4R)-4-(aminomethyl)-3-(1H-indol-3-yl)-2-propyl-3,4-dihydroisocarbostyril Formula: C21H23N3O MolecularWeight: 333.42682

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)CN)C3=CNC4=CC=CC=C43

Isomeric SMILES

CCCN1[C@@H]([C@H](C2=CC=CC=C2C1=O)CN)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C21H23N3O/c1-2-11-24-20(18-13-23-19-10-6-5-8-15(18)19)17(12-22)14-7-3-4-9-16(14)21(24)25/h3-10,13,17,20,23H,2,11-12,22H2,1H3/t17-,20-/m0/s1