2-(2-hexoxyethoxy)ethyl N-[1-[(2-phenylazanylpyridin-3-yl)methyl]pyrrolidin-3-yl]carbamate

Systemtic Name: 2-(2-hexoxyethoxy)ethyl N-[1-[(2-phenylazanylpyridin-3-yl)methyl]pyrrolidin-3-yl]carbamate Openeye Name: 2-(2-hexoxyethoxy)ethyl N-[1-[(2-anilino-3-pyridyl)methyl]pyrrolidin-3-yl]carbamate CAS Name: N-[1-[(2-anilino-3-pyridinyl)methyl]-3-pyrrolidinyl]carbamic acid 2-(2-hexoxyethoxy)ethyl ester IUPAC Name: 2-(2-hexoxyethoxy)ethyl N-[1-[(2-anilinopyridin-3-yl)methyl]pyrrolidin-3-yl]carbamate Traditional Name: N-[1-[(2-anilino-3-pyridyl)methyl]pyrrolidin-3-yl]carbamic acid 2-(2-hexoxyethoxy)ethyl ester Formula: C27H40N4O4 MolecularWeight: 484.6309

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOCCOCCOC(=O)NC1CCN(C1)CC2=C(N=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CCCCCCOCCOCCOC(=O)NC1CCN(C1)CC2=C(N=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C27H40N4O4/c1-2-3-4-8-16-33-17-18-34-19-20-35-27(32)30-25-13-15-31(22-25)21-23-10-9-14-28-26(23)29-24-11-6-5-7-12-24/h5-7,9-12,14,25H,2-4,8,13,15-22H2,1H3,(H,28,29)(H,30,32)