ethyl 2-[4-nitro-1-(phenylmethyl)pyrrolidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[4-nitro-1-(phenylmethyl)pyrrolidin-3-yl]ethanoate Openeye Name: ethyl 2-(1-benzyl-4-nitro-pyrrolidin-3-yl)acetate CAS Name: 2-[4-nitro-1-(phenylmethyl)-3-pyrrolidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-(1-benzyl-4-nitropyrrolidin-3-yl)acetate Traditional Name: 2-(1-benzyl-4-nitro-pyrrolidin-3-yl)acetic acid ethyl ester Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CN(CC1[N+](=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CC1CN(CC1[N+](=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C15H20N2O4/c1-2-21-15(18)8-13-10-16(11-14(13)17(19)20)9-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11H2,1H3