methyl 4-[(2R)-1-(3-azanylpyrazin-2-yl)carbonylpyrrolidin-2-yl]-3-methyl-benzoate

Systemtic Name: methyl 4-[(2R)-1-(3-azanylpyrazin-2-yl)carbonylpyrrolidin-2-yl]-3-methyl-benzoate Openeye Name: methyl 4-[(2R)-1-(3-aminopyrazine-2-carbonyl)pyrrolidin-2-yl]-3-methyl-benzoate CAS Name: 4-[(2R)-1-[(3-amino-2-pyrazinyl)-oxomethyl]-2-pyrrolidinyl]-3-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[(2R)-1-(3-aminopyrazine-2-carbonyl)pyrrolidin-2-yl]-3-methylbenzoate Traditional Name: 4-[(2R)-1-(3-aminopyrazinoyl)pyrrolidin-2-yl]-3-methyl-benzoic acid methyl ester Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)C2CCCN2C(=O)C3=NC=CN=C3N

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)[C@H]2CCCN2C(=O)C3=NC=CN=C3N

InChI

InChI=1S/C18H20N4O3/c1-11-10-12(18(24)25-2)5-6-13(11)14-4-3-9-22(14)17(23)15-16(19)21-8-7-20-15/h5-8,10,14H,3-4,9H2,1-2H3,(H2,19,21)/t14-/m1/s1