13-cyclohexyl-4-(2-piperidin-4-ylethoxy)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid

Systemtic Name: 13-cyclohexyl-4-(2-piperidin-4-ylethoxy)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Openeye Name: 13-cyclohexyl-4-[2-(4-piperidyl)ethoxy]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid CAS Name: 13-cyclohexyl-4-[2-(4-piperidinyl)ethoxy]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid IUPAC Name: 13-cyclohexyl-4-(2-piperidin-4-ylethoxy)-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Traditional Name: 13-cyclohexyl-4-[2-(4-piperidyl)ethoxy]-6,7-dihydroindolo[1,2-d][1,4]benzoxazepine-10-carboxylic acid Formula: C30H36N2O4 MolecularWeight: 488.61784

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C3C4=C(C(=CC=C4)OCCC5CCNCC5)OCCN3C6=C2C=CC(=C6)C(=O)O

Isomeric SMILES

C1CCC(CC1)C2=C3C4=C(C(=CC=C4)OCCC5CCNCC5)OCCN3C6=C2C=CC(=C6)C(=O)O

InChI

InChI=1S/C30H36N2O4/c33-30(34)22-9-10-23-25(19-22)32-16-18-36-29-24(28(32)27(23)21-5-2-1-3-6-21)7-4-8-26(29)35-17-13-20-11-14-31-15-12-20/h4,7-10,19-21,31H,1-3,5-6,11-18H2,(H,33,34)