2-pyrrolidin-1-ylethyl 5-phenyl-3,4-dihydro-2H-1-benzoxepine-5-carboxylate

Systemtic Name: 2-pyrrolidin-1-ylethyl 5-phenyl-3,4-dihydro-2H-1-benzoxepine-5-carboxylate Openeye Name: 2-pyrrolidin-1-ylethyl 5-phenyl-3,4-dihydro-2H-1-benzoxepine-5-carboxylate CAS Name: 5-phenyl-3,4-dihydro-2H-1-benzoxepin-5-carboxylic acid 2-(1-pyrrolidinyl)ethyl ester IUPAC Name: 2-pyrrolidin-1-ylethyl 5-phenyl-3,4-dihydro-2H-1-benzoxepine-5-carboxylate Traditional Name: 5-phenyl-3,4-dihydro-2H-1-benzoxepin-5-carboxylic acid 2-pyrrolidinoethyl ester Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC(=O)C2(CCCOC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)CCOC(=O)C2(CCCOC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H27NO3/c25-22(27-18-16-24-14-6-7-15-24)23(19-9-2-1-3-10-19)13-8-17-26-21-12-5-4-11-20(21)23/h1-5,9-12H,6-8,13-18H2