3-[5-(6-methoxynaphthalen-1-yl)-1,3-dioxan-2-yl]propyl 2-azanylbutanoate

Systemtic Name: 3-[5-(6-methoxynaphthalen-1-yl)-1,3-dioxan-2-yl]propyl 2-azanylbutanoate Openeye Name: 3-[5-(6-methoxy-1-naphthyl)-1,3-dioxan-2-yl]propyl 2-aminobutanoate CAS Name: 2-aminobutanoic acid 3-[5-(6-methoxy-1-naphthalenyl)-1,3-dioxan-2-yl]propyl ester IUPAC Name: 3-[5-(6-methoxynaphthalen-1-yl)-1,3-dioxan-2-yl]propyl 2-aminobutanoate Traditional Name: 2-aminobutyric acid 3-[5-(6-methoxy-1-naphthyl)-1,3-dioxan-2-yl]propyl ester Formula: C22H29NO5 MolecularWeight: 387.46936

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCCCC1OCC(CO1)C2=CC=CC3=C2C=CC(=C3)OC)N

Isomeric SMILES

CCC(C(=O)OCCCC1OCC(CO1)C2=CC=CC3=C2C=CC(=C3)OC)N

InChI

InChI=1S/C22H29NO5/c1-3-20(23)22(24)26-11-5-8-21-27-13-16(14-28-21)18-7-4-6-15-12-17(25-2)9-10-19(15)18/h4,6-7,9-10,12,16,20-21H,3,5,8,11,13-14,23H2,1-2H3