ethyl 2-[[3-[[(2S)-butan-2-yl]carbamoyl]-4-piperidin-1-yl-phenyl]carbamoylamino]ethanoate

Systemtic Name: ethyl 2-[[3-[[(2S)-butan-2-yl]carbamoyl]-4-piperidin-1-yl-phenyl]carbamoylamino]ethanoate Openeye Name: ethyl 2-[[3-[[(1S)-1-methylpropyl]carbamoyl]-4-(1-piperidyl)phenyl]carbamoylamino]acetate CAS Name: 2-[[[3-[[[(2S)-butan-2-yl]amino]-oxomethyl]-4-(1-piperidinyl)anilino]-oxomethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[3-[[(2S)-butan-2-yl]carbamoyl]-4-piperidin-1-ylphenyl]carbamoylamino]acetate Traditional Name: 2-[[3-[[(1S)-1-methylpropyl]carbamoyl]-4-piperidino-phenyl]carbamoylamino]acetic acid ethyl ester Formula: C21H32N4O4 MolecularWeight: 404.50318

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)NCC(=O)OCC)N2CCCCC2

Isomeric SMILES

CC[C@H](C)NC(=O)C1=C(C=CC(=C1)NC(=O)NCC(=O)OCC)N2CCCCC2

InChI

InChI=1S/C21H32N4O4/c1-4-15(3)23-20(27)17-13-16(24-21(28)22-14-19(26)29-5-2)9-10-18(17)25-11-7-6-8-12-25/h9-10,13,15H,4-8,11-12,14H2,1-3H3,(H,23,27)(H2,22,24,28)/t15-/m0/s1