7-[[(3E)-5-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxidanylidene-3-(phenylmethylidene)indol-1-yl]methyl]naphthalene-2-carboximidamide

Systemtic Name: 7-[[(3E)-5-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxidanylidene-3-(phenylmethylidene)indol-1-yl]methyl]naphthalene-2-carboximidamide Openeye Name: 7-[[(3E)-3-benzylidene-5-[(1-ethanimidoyl-4-piperidyl)oxy]-2-oxo-indolin-1-yl]methyl]naphthalene-2-carboxamidine CAS Name: 7-[[(3E)-5-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-2-oxo-3-(phenylmethylene)-1-indolyl]methyl]-2-naphthalenecarboximidamide IUPAC Name: 7-[[(3E)-3-benzylidene-5-(1-ethanimidoylpiperidin-4-yl)oxy-2-oxoindol-1-yl]methyl]naphthalene-2-carboximidamide Traditional Name: 7-[[(3E)-5-[(1-acetimidoyl-4-piperidyl)oxy]-3-benzal-2-keto-indolin-1-yl]methyl]-2-naphthamidine Formula: C34H33N5O2 MolecularWeight: 543.65812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(=O)C3=CC4=CC=CC=C4)CC5=CC6=C(C=C5)C=CC(=C6)C(=N)N

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC\3=C(C=C2)N(C(=O)/C3=C/C4=CC=CC=C4)CC5=CC6=C(C=C5)C=CC(=C6)C(=N)N

InChI

InChI=1S/C34H33N5O2/c1-22(35)38-15-13-28(14-16-38)41-29-11-12-32-30(20-29)31(18-23-5-3-2-4-6-23)34(40)39(32)21-24-7-8-25-9-10-26(33(36)37)19-27(25)17-24/h2-12,17-20,28,35H,13-16,21H2,1H3,(H3,36,37)/b31-18+,35-22?