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(4S)-4-[3-(dimethylamino)propyliminomethyl]-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione

(4S)-4-[3-(dimethylamino)propyliminomethyl]-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione

Systemtic Name:(4S)-4-[3-(dimethylamino)propyliminomethyl]-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione
Openeye Name:(4S)-4-[3-(dimethylamino)propyliminomethyl]-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione
CAS Name:(4S)-4-[3-(dimethylamino)propyliminomethyl]-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione
IUPAC Name:(4S)-4-[3-(dimethylamino)propyliminomethyl]-2-(4-ethoxyphenyl)-4H-isoquinoline-1,3-dione
Traditional Name:(4S)-4-[3-(dimethylamino)propyliminomethyl]-2-p-phenetyl-4H-isoquinoline-1,3-quinone
Formula: C23H27N3O3
MolecularWeight: 393.47878
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=O)C(C3=CC=CC=C3C2=O)C=NCCCN(C)C


Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=O)[C@@H](C3=CC=CC=C3C2=O)C=NCCCN(C)C


InChI

InChI=1S/C23H27N3O3/c1-4-29-18-12-10-17(11-13-18)26-22(27)20-9-6-5-8-19(20)21(23(26)28)16-24-14-7-15-25(2)3/h5-6,8-13,16,21H,4,7,14-15H2,1-3H3/t21-/m1/s1


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