2-diethylaminoethyl 4-[2-(8-methyl-4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanoylamino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[2-(8-methyl-4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanoylamino]benzoate Openeye Name: 2-diethylaminoethyl 4-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)-1-oxoethyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[[2-(8-methyl-4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(4-keto-8-methyl-2H-pyridazin[4,5-b]indol-3-yl)acetyl]amino]benzoic acid 2-diethylaminoethyl ester Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=NC4=C(C3=CN2)C=C(C=C4)C

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C3=NC4=C(C3=CN2)C=C(C=C4)C

InChI

InChI=1S/C26H29N5O4/c1-4-30(5-2)12-13-35-26(34)18-7-9-19(10-8-18)28-23(32)16-31-25(33)24-21(15-27-31)20-14-17(3)6-11-22(20)29-24/h6-11,14-15,27H,4-5,12-13,16H2,1-3H3,(H,28,32)