ethyl N-(ethoxycarbonylamino)-N-[1-methyl-5-nonyl-2-(phenylmethyl)pyrrolidin-3-yl]carbamate

Systemtic Name: ethyl N-(ethoxycarbonylamino)-N-[1-methyl-5-nonyl-2-(phenylmethyl)pyrrolidin-3-yl]carbamate Openeye Name: ethyl N-(2-benzyl-1-methyl-5-nonyl-pyrrolidin-3-yl)-N-(ethoxycarbonylamino)carbamate CAS Name: N-(ethoxycarbonylamino)-N-[1-methyl-5-nonyl-2-(phenylmethyl)-3-pyrrolidinyl]carbamic acid ethyl ester IUPAC Name: ethyl N-(2-benzyl-1-methyl-5-nonylpyrrolidin-3-yl)-N-(ethoxycarbonylamino)carbamate Traditional Name: N-(2-benzyl-1-methyl-5-nonyl-pyrrolidin-3-yl)-N-(carbethoxyamino)carbamic acid ethyl ester Formula: C27H45N3O4 MolecularWeight: 475.6639

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1CC(C(N1C)CC2=CC=CC=C2)N(C(=O)OCC)NC(=O)OCC

Isomeric SMILES

CCCCCCCCCC1CC(C(N1C)CC2=CC=CC=C2)N(C(=O)OCC)NC(=O)OCC

InChI

InChI=1S/C27H45N3O4/c1-5-8-9-10-11-12-16-19-23-21-25(24(29(23)4)20-22-17-14-13-15-18-22)30(27(32)34-7-3)28-26(31)33-6-2/h13-15,17-18,23-25H,5-12,16,19-21H2,1-4H3,(H,28,31)