[4,6-bis(chloranyl)-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-3-methoxy-phenyl] nonanoate

Systemtic Name: [4,6-bis(chloranyl)-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-3-methoxy-phenyl] nonanoate Openeye Name: [4,6-dichloro-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-3-methoxy-phenyl] nonanoate CAS Name: nonanoic acid [4,6-dichloro-2-[[(1-ethyl-2-pyrrolidinyl)methylamino]-oxomethyl]-3-methoxyphenyl] ester IUPAC Name: [4,6-dichloro-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-3-methoxyphenyl] nonanoate Traditional Name: pelargonic acid [4,6-dichloro-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoyl]-3-methoxy-phenyl] ester Formula: C24H36Cl2N2O4 MolecularWeight: 487.45964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)OC1=C(C(=C(C=C1Cl)Cl)OC)C(=O)NCC2CCCN2CC

Isomeric SMILES

CCCCCCCCC(=O)OC1=C(C(=C(C=C1Cl)Cl)OC)C(=O)NCC2CCCN2CC

InChI

InChI=1S/C24H36Cl2N2O4/c1-4-6-7-8-9-10-13-20(29)32-23-19(26)15-18(25)22(31-3)21(23)24(30)27-16-17-12-11-14-28(17)5-2/h15,17H,4-14,16H2,1-3H3,(H,27,30)