N-but-3-yn-2-yloxy-8-(2-dimethylaminoethyloxy)-2,3-diethoxy-indeno[1,2-b]indol-10-amine hydrochloride

Systemtic Name: N-but-3-yn-2-yloxy-8-(2-dimethylaminoethyloxy)-2,3-diethoxy-indeno[1,2-b]indol-10-amine hydrochloride Openeye Name: 8-(2-dimethylaminoethyloxy)-2,3-diethoxy-N-(1-methylprop-2-ynoxy)indeno[1,2-b]indol-10-amine hydrochloride CAS Name: N-but-3-yn-2-yloxy-8-(2-dimethylaminoethyloxy)-2,3-diethoxy-10-indeno[1,2-b]indolamine hydrochloride IUPAC Name: N-but-3-yn-2-yloxy-8-(2-dimethylaminoethyloxy)-2,3-diethoxyindeno[1,2-b]indol-10-amine hydrochloride Traditional Name: 2-[2,3-diethoxy-10-(1-methylprop-2-ynoxyamino)inden[1,2-b]indol-8-yl]oxyethyl-dimethyl-amine hydrochloride Formula: C27H32ClN3O4 MolecularWeight: 498.01368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=C3C2=NC4=C3C=C(C=C4)OCCN(C)C)NOC(C)C#C)OCC.Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=C3C2=NC4=C3C=C(C=C4)OCCN(C)C)NOC(C)C#C)OCC.Cl

InChI

InChI=1S/C27H31N3O4.ClH/c1-7-17(4)34-29-27-20-16-24(32-9-3)23(31-8-2)15-19(20)26-25(27)21-14-18(10-11-22(21)28-26)33-13-12-30(5)6;/h1,10-11,14-17,29H,8-9,12-13H2,2-6H3;1H