ethyl 2-[4-[(1-methylindol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(1-methylindol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]ethanoate Openeye Name: ethyl 2-[4-[(1-methylindol-3-yl)methyl]-1-oxo-phthalazin-2-yl]acetate CAS Name: 2-[4-[(1-methyl-3-indolyl)methyl]-1-oxo-2-phthalazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(1-methylindol-3-yl)methyl]-1-oxophthalazin-2-yl]acetate Traditional Name: 2-[1-keto-4-[(1-methylindol-3-yl)methyl]phthalazin-2-yl]acetic acid ethyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)CN1C(=O)C2=CC=CC=C2C(=N1)CC3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C22H21N3O3/c1-3-28-21(26)14-25-22(27)18-10-5-4-9-17(18)19(23-25)12-15-13-24(2)20-11-7-6-8-16(15)20/h4-11,13H,3,12,14H2,1-2H3