methyl 4-[[(1R)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[(1R)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]amino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[[(1R)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]amino]-4-oxo-butanoate CAS Name: 4-[[(1R)-1-[2-(1-azocanyl)-4-methyl-5-pyrimidinyl]ethyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[[(1R)-1-[2-(azocan-1-yl)-4-methylpyrimidin-5-yl]ethyl]amino]-4-oxobutanoate Traditional Name: 4-[[(1R)-1-[2-(azocan-1-yl)-4-methyl-pyrimidin-5-yl]ethyl]amino]-4-keto-butyric acid methyl ester Formula: C19H30N4O3 MolecularWeight: 362.4665

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NC(=O)CCC(=O)OC)N2CCCCCCC2

Isomeric SMILES

CC1=NC(=NC=C1[C@@H](C)NC(=O)CCC(=O)OC)N2CCCCCCC2

InChI

InChI=1S/C19H30N4O3/c1-14(21-17(24)9-10-18(25)26-3)16-13-20-19(22-15(16)2)23-11-7-5-4-6-8-12-23/h13-14H,4-12H2,1-3H3,(H,21,24)/t14-/m1/s1