ethyl 2-[4-[[1-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]phenyl]ethanoate

Systemtic Name: ethyl 2-[4-[[1-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-oxidanylidene-indol-3-ylidene]amino]phenyl]ethanoate Openeye Name: ethyl 2-[4-[[1-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-oxo-indolin-3-ylidene]amino]phenyl]acetate CAS Name: 2-[4-[[1-[(4-methyl-1-piperidin-1-iumyl)methyl]-2-oxo-3-indolylidene]amino]phenyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[[1-[(4-methylpiperidin-1-ium-1-yl)methyl]-2-oxoindol-3-ylidene]amino]phenyl]acetate Traditional Name: 2-[4-[[2-keto-1-[(4-methylpiperidin-1-ium-1-yl)methyl]indolin-3-ylidene]amino]phenyl]acetic acid ethyl ester Formula: C25H30N3O3+ MolecularWeight: 420.524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCC(CC4)C

Isomeric SMILES

CCOC(=O)CC1=CC=C(C=C1)N=C2C3=CC=CC=C3N(C2=O)C[NH+]4CCC(CC4)C

InChI

InChI=1S/C25H29N3O3/c1-3-31-23(29)16-19-8-10-20(11-9-19)26-24-21-6-4-5-7-22(21)28(25(24)30)17-27-14-12-18(2)13-15-27/h4-11,18H,3,12-17H2,1-2H3/p+1