2-[[7-(1-ethanimidoylpiperidin-4-yl)oxy-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]-1-methyl-indole-6-carboximidamide

Systemtic Name: 2-[[7-(1-ethanimidoylpiperidin-4-yl)oxy-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]-1-methyl-indole-6-carboximidamide Openeye Name: 2-[[7-[(1-ethanimidoyl-4-piperidyl)oxy]-3-oxo-1,4-benzoxazin-4-yl]methyl]-1-methyl-indole-6-carboxamidine CAS Name: 2-[[7-[[1-(1-iminoethyl)-4-piperidinyl]oxy]-3-oxo-1,4-benzoxazin-4-yl]methyl]-1-methyl-6-indolecarboximidamide IUPAC Name: 2-[[7-(1-ethanimidoylpiperidin-4-yl)oxy-3-oxo-1,4-benzoxazin-4-yl]methyl]-1-methylindole-6-carboximidamide Traditional Name: 2-[[7-[(1-acetimidoyl-4-piperidyl)oxy]-3-keto-1,4-benzoxazin-4-yl]methyl]-1-methyl-indole-6-carboxamidine Formula: C26H30N6O3 MolecularWeight: 474.5548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(=O)CO3)CC4=CC5=C(N4C)C=C(C=C5)C(=N)N

Isomeric SMILES

CC(=N)N1CCC(CC1)OC2=CC3=C(C=C2)N(C(=O)CO3)CC4=CC5=C(N4C)C=C(C=C5)C(=N)N

InChI

InChI=1S/C26H30N6O3/c1-16(27)31-9-7-20(8-10-31)35-21-5-6-22-24(13-21)34-15-25(33)32(22)14-19-11-17-3-4-18(26(28)29)12-23(17)30(19)2/h3-6,11-13,20,27H,7-10,14-15H2,1-2H3,(H3,28,29)