(4S)-4-[3-(cyclopropylmethoxy)propyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione

Systemtic Name: (4S)-4-[3-(cyclopropylmethoxy)propyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Openeye Name: (4S)-4-[3-(cyclopropylmethoxy)propyliminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-dione CAS Name: (4S)-4-[3-(cyclopropylmethoxy)propyliminomethyl]-2-(2-pyridinyl)-4H-isoquinoline-1,3-dione IUPAC Name: (4S)-4-[3-(cyclopropylmethoxy)propyliminomethyl]-2-pyridin-2-yl-4H-isoquinoline-1,3-dione Traditional Name: (4S)-4-[3-(cyclopropylmethoxy)propyliminomethyl]-2-(2-pyridyl)-4H-isoquinoline-1,3-quinone Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COCCCN=CC2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

C1CC1COCCCN=C[C@@H]2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C22H23N3O3/c26-21-18-7-2-1-6-17(18)19(14-23-11-5-13-28-15-16-9-10-16)22(27)25(21)20-8-3-4-12-24-20/h1-4,6-8,12,14,16,19H,5,9-11,13,15H2/t19-/m1/s1