2-[2-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]pyrrolidine-1-carboxylate

Systemtic Name: 2-[2-[4-[3-(4-cyclopropylcarbonylphenoxy)propyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]pyrrolidine-1-carboxylate Openeye Name: 2-[2-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]pyrrolidine-1-carboxylate CAS Name: 2-[2-[4-[3-[4-[cyclopropyl(oxo)methyl]phenoxy]propyl]-1,4-diazepan-1-yl]-2-oxoethyl]-1-pyrrolidinecarboxylate IUPAC Name: 2-[2-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]-1,4-diazepan-1-yl]-2-oxoethyl]pyrrolidine-1-carboxylate Traditional Name: 2-[2-[4-[3-[4-(cyclopropanecarbonyl)phenoxy]propyl]-1,4-diazepan-1-yl]-2-keto-ethyl]pyrrolidine-1-carboxylate Formula: C25H34N3O5- MolecularWeight: 456.55456

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)[O-])CC(=O)N2CCCN(CC2)CCCOC3=CC=C(C=C3)C(=O)C4CC4

Isomeric SMILES

C1CC(N(C1)C(=O)[O-])CC(=O)N2CCCN(CC2)CCCOC3=CC=C(C=C3)C(=O)C4CC4

InChI

InChI=1S/C25H35N3O5/c29-23(18-21-4-1-14-28(21)25(31)32)27-13-2-11-26(15-16-27)12-3-17-33-22-9-7-20(8-10-22)24(30)19-5-6-19/h7-10,19,21H,1-6,11-18H2,(H,31,32)/p-1