6-ethoxy-3-(2-methylpropylcarbamoylamino)-3-naphthalen-2-yl-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-ethoxy-3-(2-methylpropylcarbamoylamino)-3-naphthalen-2-yl-6-oxidanylidene-hexanoic acid Openeye Name: 6-ethoxy-3-(isobutylcarbamoylamino)-3-(2-naphthyl)-6-oxo-hexanoic acid CAS Name: 6-ethoxy-3-[[(2-methylpropylamino)-oxomethyl]amino]-3-(2-naphthalenyl)-6-oxohexanoic acid IUPAC Name: 6-ethoxy-3-(2-methylpropylcarbamoylamino)-3-naphthalen-2-yl-6-oxohexanoic acid Traditional Name: 6-ethoxy-3-(isobutylcarbamoylamino)-6-keto-3-(2-naphthyl)hexanoic acid Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(CC(=O)O)(C1=CC2=CC=CC=C2C=C1)NC(=O)NCC(C)C

Isomeric SMILES

CCOC(=O)CCC(CC(=O)O)(C1=CC2=CC=CC=C2C=C1)NC(=O)NCC(C)C

InChI

InChI=1S/C23H30N2O5/c1-4-30-21(28)11-12-23(14-20(26)27,25-22(29)24-15-16(2)3)19-10-9-17-7-5-6-8-18(17)13-19/h5-10,13,16H,4,11-12,14-15H2,1-3H3,(H,26,27)(H2,24,25,29)