[1-[3,6-bis(2,2-diphenylethenyl)carbazol-9-yl]-3-chloranyl-propan-2-yl] ethanoate

Systemtic Name: [1-[3,6-bis(2,2-diphenylethenyl)carbazol-9-yl]-3-chloranyl-propan-2-yl] ethanoate Openeye Name: [1-[[3,6-bis(2,2-diphenylvinyl)carbazol-9-yl]methyl]-2-chloro-ethyl] acetate CAS Name: acetic acid [1-[3,6-bis(2,2-diphenylethenyl)-9-carbazolyl]-3-chloropropan-2-yl] ester IUPAC Name: [1-[3,6-bis(2,2-diphenylethenyl)carbazol-9-yl]-3-chloropropan-2-yl] acetate Traditional Name: acetic acid [1-[[3,6-bis(2,2-diphenylvinyl)carbazol-9-yl]methyl]-2-chloro-ethyl] ester Formula: C45H36ClNO2 MolecularWeight: 658.22584

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CN1C2=C(C=C(C=C2)C=C(C3=CC=CC=C3)C4=CC=CC=C4)C5=C1C=CC(=C5)C=C(C6=CC=CC=C6)C7=CC=CC=C7)CCl

Isomeric SMILES

CC(=O)OC(CN1C2=C(C=C(C=C2)C=C(C3=CC=CC=C3)C4=CC=CC=C4)C5=C1C=CC(=C5)C=C(C6=CC=CC=C6)C7=CC=CC=C7)CCl

InChI

InChI=1S/C45H36ClNO2/c1-32(48)49-39(30-46)31-47-44-24-22-33(26-40(35-14-6-2-7-15-35)36-16-8-3-9-17-36)28-42(44)43-29-34(23-25-45(43)47)27-41(37-18-10-4-11-19-37)38-20-12-5-13-21-38/h2-29,39H,30-31H2,1H3