methyl 4-[1-methyl-5-(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)pyrrol-2-yl]benzoate

Systemtic Name: methyl 4-[1-methyl-5-(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)pyrrol-2-yl]benzoate Openeye Name: methyl 4-[1-methyl-5-(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)pyrrol-2-yl]benzoate CAS Name: 4-[1-methyl-5-(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)-2-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 4-[1-methyl-5-(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)pyrrol-2-yl]benzoate Traditional Name: 4-[1-methyl-5-(5,5,8,8-tetramethyl-6,7-dihydroquinoxalin-2-yl)pyrrol-2-yl]benzoic acid methyl ester Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=NC(=CN=C21)C3=CC=C(N3C)C4=CC=C(C=C4)C(=O)OC)(C)C)C

Isomeric SMILES

CC1(CCC(C2=NC(=CN=C21)C3=CC=C(N3C)C4=CC=C(C=C4)C(=O)OC)(C)C)C

InChI

InChI=1S/C25H29N3O2/c1-24(2)13-14-25(3,4)22-21(24)26-15-18(27-22)20-12-11-19(28(20)5)16-7-9-17(10-8-16)23(29)30-6/h7-12,15H,13-14H2,1-6H3