[6-ethyl-2-methyl-3-(1-methylbenzimidazol-2-yl)-4-oxidanylidene-chromen-7-yl] 2-chloranylbenzoate

Systemtic Name: [6-ethyl-2-methyl-3-(1-methylbenzimidazol-2-yl)-4-oxidanylidene-chromen-7-yl] 2-chloranylbenzoate Openeye Name: [6-ethyl-2-methyl-3-(1-methylbenzimidazol-2-yl)-4-oxo-chromen-7-yl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [6-ethyl-2-methyl-3-(1-methyl-2-benzimidazolyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-2-methyl-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-7-yl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [6-ethyl-4-keto-2-methyl-3-(1-methylbenzimidazol-2-yl)chromen-7-yl] ester Formula: C27H21ClN2O4 MolecularWeight: 472.91964

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=NC4=CC=CC=C4N3C)OC(=O)C5=CC=CC=C5Cl

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=C(O2)C)C3=NC4=CC=CC=C4N3C)OC(=O)C5=CC=CC=C5Cl

InChI

InChI=1S/C27H21ClN2O4/c1-4-16-13-18-23(14-22(16)34-27(32)17-9-5-6-10-19(17)28)33-15(2)24(25(18)31)26-29-20-11-7-8-12-21(20)30(26)3/h5-14H,4H2,1-3H3