4-[[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]carbamoylamino]benzoic acid

Systemtic Name: 4-[[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]carbamoylamino]benzoic acid Openeye Name: 4-[[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]carbamoylamino]benzoic acid CAS Name: 4-[[[[4-[6-(4-morpholinylmethyl)-3-pyridinyl]-1-naphthalenyl]amino]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]carbamoylamino]benzoic acid Traditional Name: 4-[[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]carbamoylamino]benzoic acid Formula: C28H26N4O4 MolecularWeight: 482.53044

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=NC=C(C=C2)C3=CC=C(C4=CC=CC=C43)NC(=O)NC5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1COCCN1CC2=NC=C(C=C2)C3=CC=C(C4=CC=CC=C43)NC(=O)NC5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C28H26N4O4/c33-27(34)19-5-8-21(9-6-19)30-28(35)31-26-12-11-23(24-3-1-2-4-25(24)26)20-7-10-22(29-17-20)18-32-13-15-36-16-14-32/h1-12,17H,13-16,18H2,(H,33,34)(H2,30,31,35)