butyl 9-chloranyl-8-(ethylcarbamoyl)-5-(4-hydroxyphenyl)-7-oxidanyl-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate

Systemtic Name: butyl 9-chloranyl-8-(ethylcarbamoyl)-5-(4-hydroxyphenyl)-7-oxidanyl-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate Openeye Name: butyl 9-chloro-8-(ethylcarbamoyl)-7-hydroxy-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate CAS Name: 9-chloro-8-(ethylcarbamoyl)-7-hydroxy-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylic acid butyl ester IUPAC Name: butyl 9-chloro-8-(ethylcarbamoyl)-7-hydroxy-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate Traditional Name: 9-chloro-8-(ethylcarbamoyl)-7-hydroxy-5-(4-hydroxyphenyl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylic acid butyl ester Formula: C24H29ClN2O5 MolecularWeight: 460.95046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)N1CCC2=C(C(=C(C=C2C(C1)C3=CC=C(C=C3)O)O)C(=O)NCC)Cl

Isomeric SMILES

CCCCOC(=O)N1CCC2=C(C(=C(C=C2C(C1)C3=CC=C(C=C3)O)O)C(=O)NCC)Cl

InChI

InChI=1S/C24H29ClN2O5/c1-3-5-12-32-24(31)27-11-10-17-18(19(14-27)15-6-8-16(28)9-7-15)13-20(29)21(22(17)25)23(30)26-4-2/h6-9,13,19,28-29H,3-5,10-12,14H2,1-2H3,(H,26,30)